Crystallography Open Database

Information card for entry 7001859

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Structure parameters

Formula	C41 H52 Ag F3 N8 O8 S
Calculated formula	C41 H52 Ag F3 N8 O8 S
SMILES	[Ag]12([n]3n(c(cc3C)C)C(n3[n]1c(C)cc3C)c1cc(OC)c(O)cc1)[n]1n(c(C)cc1C)C(n1[n]2c(cc1C)C)c1cc(OC)c(O)cc1.C(S(=O)(=O)[O-])(F)(F)F.O1CCCC1
Title of publication	Self assembly of silver(i) coordination polymers formed through hydrogen bonding with a new ditopic heteroscorpionate ligand
Authors of publication	Santillan, Guillermo A.; Carrano, Carl J.
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	33
Pages of publication	6599 - 6605
a	12.3951 ± 0.001 Å
b	12.7251 ± 0.0011 Å
c	16.9436 ± 0.0014 Å
α	77.654 ± 0.003°
β	71.812 ± 0.003°
γ	62.334 ± 0.003°
Cell volume	2241.1 ± 0.3 Å³
Cell temperature	240 ± 2 K
Ambient diffraction temperature	240 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0758
Residual factor for significantly intense reflections	0.0458
Weighted residual factors for significantly intense reflections	0.1164
Weighted residual factors for all reflections included in the refinement	0.1319
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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